AG00C25F

Name: 4-Methyl-3-(Piperidin-1-Ylsulfonyl)Benzoic Acid
Brand: Angene Chemical
SKU: AG00C25F

300383-07-7 | 4-Methyl-3-(Piperidin-1-Ylsulfonyl)Benzoic Acid

AG00C25F

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CAS Number	300383-07-7
Catalog Number	AG00C25F(AGN-PC-0KBMY8)
Chemical Name	4-Methyl-3-(Piperidin-1-Ylsulfonyl)Benzoic Acid
IUPAC Name	4-methyl-3-piperidin-1-ylsulfonylbenzoic acid
InChI	InChI=1S/C13H17NO4S/c1-10-5-6-11(13(15)16)9-12(10)19(17,18)14-7-3-2-4-8-14/h5-6,9H,2-4,7-8H2,1H3,(H,15,16)
InChI Key	CYDFTQZJAGEURD-UHFFFAOYSA-N
MDL Number	MFCD00625729
Molecular Formula	C13H17NO4S
Molecular Weight	283.3434
SMILES	O=C(O)C1=CC=C(C)C(S(=O)(N2CCCCC2)=O)=C1
Synonyms	300383-07-7, 4-methyl-3-(piperidin-1-ylsulfonyl)benzoic acid, 4-Methyl-3-(piperidine-1-sulfonyl)benzoic acid, 4-Methyl-3-(piperidine-1-sulfonyl)-benzoic acid, 4-methyl-3-piperidin-1-ylsulfonylbenzoic acid, BAS 00116695, AC1M0UTU, AC1Q2LU9, Cambridge id 5314222, Oprea1_473751, Oprea1_573336, CHEMBL246712, SCHEMBL4719951, CTK7I7732, DTXSID80366075, ZINC2493342, MFCD00625729, AKOS000121819, MCULE-8232953762, NE11632, AS-55149, 4-methyl-3-(piperidylsulfonyl)benzoic acid, RT-020466, EU-0034654, ST24043894, ST50217098, EN300-00439, AB00080259-01, SR-01000399038, SR-01000399038-1, Z56792771, CID2057275,

Complexity	422
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.088g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.342g/mol
Monoisotopic Mass	283.088g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited